SCHEMBL14617706

SCHEMBL14617706

Cc1cccc(N(C)c2nn(-c3ccncc3)c3ncnc(N)c23)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 5/20 0.42
▸ EGFR P00533 5/20 0.41
▸ PIK3CD O00329 6/20 0.41
▸ PIK3CB P42338 4/20 0.41
▸ PIK3CG P48736 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ SRC P12931 5/20 0.40
▸ ABL1 P00519 2/20 0.40
▸ TSHR P16473 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17090652 0.85 NUDT14 (0.42) EGFRPIK3CDPIK3CBPIK3CGKDM4E
SCHEMBL24096482 0.75 PIK3CD (0.55) EGFRPIK3CDPIK3CBPIK3CGKDM4E
SCHEMBL24096486 0.69 SRC (0.50) EGFRPIK3CDPIK3CBPIK3CGKDM4E
SCHEMBL13020102 0.67 EGFR (0.47) CSF1REGFRPIK3CDPIK3CBPIK3CG
SCHEMBL3403614 0.67 KDM4E (0.55) EGFRPIK3CDPIK3CBKDM4ENPC1
SCHEMBL17264219 0.66 SRC (0.52) EGFRKDM4ENPC1HTTRAB9A
SCHEMBL13367477 0.66 KDM4C (0.46) CSF1REGFRTSHR
SCHEMBL3785235 0.65 PIK3CD (0.51) EGFRPIK3CDPIK3CBPIK3CGKDM4E
SCHEMBL13063879 0.65 SRC (0.61) CSF1REGFRPIK3CDPIK3CBPIK3CG
SCHEMBL23997145 0.65 SRC (0.55) EGFRPIK3CDPIK3CBPIK3CGKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9862722-B2 Inhibitors of Bruton's tyrosine kinase PHARMACYCLICS LLC (US) 2018-01-09 — — US disclosed
US-20150329550-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS LLC (US) 2015-11-19 — — US disclosed
US-9138436-B2 Inhibitors of Bruton's tyrosine kinase PHARMACYCLICS LLC (US) 2015-09-22 — — US disclosed
US-20130018032-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS, INC. (US) 2013-01-17 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150329550-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE ABL1, BTK, ABL2 CSF1R 2589/4885EGFR 947/4885PIK3CD 534/4885
US-20130018032-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE ABL1, BTK, ABL2 CSF1R 2589/4885EGFR 947/4885PIK3CD 534/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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